2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide

C14H17ClF2N2O — CID 82889686

IUPAC2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide
SMILESO=C(CNc1c(F)cc(F)cc1Cl)NC1CCCCC1
InChIInChI=1S/C14H17ClF2N2O/c15-11-6-9(16)7-12(17)14(11)18-8-13(20)19-10-4-2-1-3-5-10/h6-7,10,18H,1-5,8H2,(H,19,20)
InChIKeyGMWLTSRAYMKQCO-UHFFFAOYSA-N
MW302.75 g/mol
LogP3.48
Rot. Bonds4

About 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide

2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide (PubChem CID 82889686) has the molecular formula C14H17ClF2N2O and a molecular weight of 302.75 g/mol. Its IUPAC name is 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide.

Molecular Properties

Compound Name2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide
PubChem CID82889686
Molecular FormulaC14H17ClF2N2O
Molecular Weight302.75 g/mol
Exact Mass302.10
IUPAC Name2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide
SMILESO=C(CNc1c(F)cc(F)cc1Cl)NC1CCCCC1
InChIInChI=1S/C14H17ClF2N2O/c15-11-6-9(16)7-12(17)14(11)18-8-13(20)19-10-4-2-1-3-5-10/h6-7,10,18H,1-5,8H2,(H,19,20)
InChIKeyGMWLTSRAYMKQCO-UHFFFAOYSA-N
XLogP3.48
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.75
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-chloro-4,6-dimethylanilino)-N-cyclopentylacetamide
CID 108993493
N-cyclohexyl-2-(2,6-difluoroanilino)acetamide
CID 28879040
N-cyclopentyl-2-(2,6-difluoroanilino)acetamide
CID 28879037
N-cyclopentyl-2-(2,4-difluoroanilino)acetamide
CID 28582841
N-cycloheptyl-2-(3,4,5-trifluoroanilino)acetamide
CID 62810286
N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide
CID 62815906
N-carbamoyl-2-(2-chloro-4,6-difluoroanilino)acetamide
CID 82889170
N-cyclopentyl-2-(2,4-dichloroanilino)acetamide
CID 28572342
N-cyclohexyl-2-(2,6-dichloro-4-fluoroanilino)propanamide
CID 83077775
N-(2-chloro-4-fluorophenyl)-2-[[2-(cycloheptylamino)-2-oxoethyl]amino]benzamide
CID 55898377
N-cyclohexyl-2-(2,5-dichloro-4-methylanilino)acetamide
CID 104726780
2-[(3-chloro-4-fluorophenyl)methylamino]-N-cyclohexylacetamide
CID 62537472

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide?
The IUPAC name of 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide (CID 82889686) is 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide.
What is the SMILES notation for 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide?
The canonical SMILES for 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide is O=C(CNc1c(F)cc(F)cc1Cl)NC1CCCCC1.
What is the InChIKey of 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide?
The InChIKey is GMWLTSRAYMKQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClF2N2O/c15-11-6-9(16)7-12(17)14(11)18-8-13(20)19-10-4-2-1-3-5-10/h6-7,10,18H,1-5,8H2,(H,19,20).
What are the key properties of 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide?
2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide has a molecular weight of 302.75 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide is sourced from PubChem (CID 82889686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).